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129835-18-3 | Adenosine, 2'-deoxy-5'-O-[(1,1-dimethylethyl)diphenylsilyl]-
CAS No: 129835-18-3 Catalog No: AG000TQG MDL No:
Product Description
Catalog Number:
AG000TQG
Chemical Name:
Adenosine, 2'-deoxy-5'-O-[(1,1-dimethylethyl)diphenylsilyl]-
CAS Number:
129835-18-3
Molecular Formula:
C26H31N5O3Si
Molecular Weight:
489.6415
IUPAC Name:
(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-3-ol
InChI:
InChI=1S/C26H31N5O3Si/c1-26(2,3)35(18-10-6-4-7-11-18,19-12-8-5-9-13-19)33-15-21-20(32)14-22(34-21)31-17-30-23-24(27)28-16-29-25(23)31/h4-13,16-17,20-22,32H,14-15H2,1-3H3,(H2,27,28,29)/t20-,21+,22+/m0/s1
InChI Key:
LXEXLEJMTPMTAW-BHDDXSALSA-N
SMILES:
O[C@H]1C[C@@H](O[C@@H]1CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)n1cnc2c1ncnc2N
Properties
Complexity:
679
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
489.22g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
489.651g/mol
Monoisotopic Mass:
489.22g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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